S-methyl N-(2-methyl-4-oxopentan-2-yl)carbamothioate
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S-methyl N-(2-methyl-4-oxopentan-2-yl)carbamothioate
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CAS No:
331247-18-8
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Formula:
C8H15NO2S
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Chemical Name:
S-methyl N-(2-methyl-4-oxopentan-2-yl)carbamothioate
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Synonyms:
ZINC2262078;STK838104;AKOS000538598;MCULE-6309583090;S-methyl (2-methyl-4-oxopentan-2-yl)carbamothioate;S-methyl N-(1,1-dimethyl-3-oxobutyl)thiocarbamate;331247-18-8
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CAS No:
S-methyl N-(2-methyl-4-oxopentan-2-yl)carbamothioate Basic Attributes
189.28 g/mol
189.08234989 g/mol
Computed Properties
Molecular Weight:189.28
XLogP3:0.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:189.08234989
Monoisotopic Mass:189.08234989
Topological Polar Surface Area:71.5
Heavy Atom Count:12
Complexity:190
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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